5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine

C6H6BrN7 — CID 130540599

IUPAC5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine
SMILESBrc1cnc(NCc2nn[nH]n2)cn1
InChIInChI=1S/C6H6BrN7/c7-4-1-9-5(2-8-4)10-3-6-11-13-14-12-6/h1-2H,3H2,(H,9,10)(H,11,12,13,14)
InChIKeyRFAAHYQODMPNJU-UHFFFAOYSA-N
MW256.07 g/mol
LogP0.36
Rot. Bonds3

About 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine

5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine (PubChem CID 130540599) has the molecular formula C6H6BrN7 and a molecular weight of 256.07 g/mol. Its IUPAC name is 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine
PubChem CID130540599
Molecular FormulaC6H6BrN7
Molecular Weight256.07 g/mol
Exact Mass254.99
IUPAC Name5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine
SMILESBrc1cnc(NCc2nn[nH]n2)cn1
InChIInChI=1S/C6H6BrN7/c7-4-1-9-5(2-8-4)10-3-6-11-13-14-12-6/h1-2H,3H2,(H,9,10)(H,11,12,13,14)
InChIKeyRFAAHYQODMPNJU-UHFFFAOYSA-N
XLogP0.36
TPSA92.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.07
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-N-[(4-phenylphenyl)methyl]pyrazin-2-amine
CID 86614306
5-methyl-N-(2H-tetrazol-5-ylmethyl)pyrimidin-2-amine
CID 63207979
6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine
CID 106194524
5-bromo-N-[2-(1H-imidazol-2-yl)ethyl]pyrazin-2-amine
CID 130540621
6-(2H-tetrazol-5-ylmethylamino)pyridine-2-carbonitrile
CID 64589167
4-bromo-2-methyl-5-(2H-tetrazol-5-ylmethylamino)pyridazin-3-one
CID 115624220
1-[(5-bromopyrazin-2-yl)amino]-2-methylbutan-2-ol
CID 126979873
5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine
CID 70706972
2-(2H-tetrazol-5-ylmethylamino)-1,3-thiazole-5-carboxylic acid
CID 80571029
N-(2H-tetrazol-5-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 126816115
4,6-dichloro-N-(2H-tetrazol-5-ylmethyl)-1,3,5-triazin-2-amine
CID 106194511
3-N-(2H-tetrazol-5-ylmethyl)pyridine-3,4-diamine
CID 130570788

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine?
The IUPAC name of 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine (CID 130540599) is 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine.
What is the SMILES notation for 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine?
The canonical SMILES for 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine is Brc1cnc(NCc2nn[nH]n2)cn1.
What is the InChIKey of 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine?
The InChIKey is RFAAHYQODMPNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6BrN7/c7-4-1-9-5(2-8-4)10-3-6-11-13-14-12-6/h1-2H,3H2,(H,9,10)(H,11,12,13,14).
What are the key properties of 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine?
5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine has a molecular weight of 256.07 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2H-tetrazol-5-ylmethyl)pyrazin-2-amine is sourced from PubChem (CID 130540599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).